AA87703
161718-81-6 | 4-Isobutyloxy-1,3-benzenedicarbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AA87703
ChemicalName
4-Isobutyloxy-1,3-benzenedicarbonitrile
CasNumber
161718-81-6
MolecularFormula
C12H12N2O
MolecularWeight
200.2365
MdlNumber
MFCD13185905
Smiles
N#Cc1cc(C#N)ccc1OCC(C)C
Complexity
293
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AA87703
ChemicalName: 4-Isobutyloxy-1,3-benzenedicarbonitrile
CasNumber: 161718-81-6
MolecularFormula: C12H12N2O
MolecularWeight: 200.2365
MdlNumber: MFCD13185905
Smiles: N#Cc1cc(C#N)ccc1OCC(C)C
Complexity: 293
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AA87703
ChemicalName:
4-Isobutyloxy-1,3-benzenedicarbonitrile
CasNumber:
161718-81-6
MolecularFormula:
C12H12N2O
MolecularWeight:
200.2365
MdlNumber:
MFCD13185905
Smiles:
N#Cc1cc(C#N)ccc1OCC(C)C
Complexity:
293
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: SC1CN(C1)C1=NCCS1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
SC1CN(C1)C1=NCCS1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)SC1CN(C1)C1=NCCS1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)SC1CN(C1)C1=NCCS1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC1CN(C1)C1=NCCS1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC1CN(C1)C1=NCCS1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__